6-bromanyl-N-(2-methyl-3-nitro-phenyl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(2-methyl-3-nitro-phenyl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-(2-methyl-3-nitro-phenyl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-(2-methyl-3-nitrophenyl)-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-(2-methyl-3-nitrophenyl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-(2-methyl-3-nitro-phenyl)-2-(3-pyridyl)cinchoninamide Formula: C22H15BrN4O3 MolecularWeight: 463.2835

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CN=CC=C4

InChI

InChI=1S/C22H15BrN4O3/c1-13-18(5-2-6-21(13)27(29)30)26-22(28)17-11-20(14-4-3-9-24-12-14)25-19-8-7-15(23)10-16(17)19/h2-12H,1H3,(H,26,28)